2,5-bis(chloranyl)-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-3,6-dimethyl-benzenesulfonamide

Systemtic Name: 2,5-bis(chloranyl)-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-3,6-dimethyl-benzenesulfonamide Openeye Name: 2,5-dichloro-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-3,6-dimethyl-benzenesulfonamide CAS Name: 2,5-dichloro-N-[2-(2-hydroxyethylamino)-5-nitrophenyl]-3,6-dimethylbenzenesulfonamide IUPAC Name: 2,5-dichloro-N-[2-(2-hydroxyethylamino)-5-nitrophenyl]-3,6-dimethylbenzenesulfonamide Traditional Name: 2,5-dichloro-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-3,6-dimethyl-benzenesulfonamide Formula: C16H17Cl2N3O5S MolecularWeight: 434.29428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])NCCO)C)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])NCCO)C)Cl

InChI

InChI=1S/C16H17Cl2N3O5S/c1-9-7-12(17)10(2)16(15(9)18)27(25,26)20-14-8-11(21(23)24)3-4-13(14)19-5-6-22/h3-4,7-8,19-20,22H,5-6H2,1-2H3